N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline

C10H17N3O — CID 115260467

IUPACN-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline
SMILESCOc1c(C)cc(C)cc1NCNN
InChIInChI=1S/C10H17N3O/c1-7-4-8(2)10(14-3)9(5-7)12-6-13-11/h4-5,12-13H,6,11H2,1-3H3
InChIKeyNMJRUJDGVPPKRO-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.14
Rot. Bonds4

About N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline

N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline (PubChem CID 115260467) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline.

Molecular Properties

Compound NameN-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline
PubChem CID115260467
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline
SMILESCOc1c(C)cc(C)cc1NCNN
InChIInChI=1S/C10H17N3O/c1-7-4-8(2)10(14-3)9(5-7)12-6-13-11/h4-5,12-13H,6,11H2,1-3H3
InChIKeyNMJRUJDGVPPKRO-UHFFFAOYSA-N
XLogP1.14
TPSA59.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-methoxy-3,5-dimethylanilino)ethanol
CID 82491310
methyl 2-(2-methoxy-3,5-dimethylanilino)acetate
CID 115232671
2-ethyl-N'-(2-methoxy-3,5-dimethylphenyl)propane-1,3-diamine
CID 115251223
3-amino-N-(2-methoxy-3,5-dimethylphenyl)-2,2-dimethylpropanamide
CID 115154505
N'-(2-methoxy-3,5-dimethylphenyl)oxamide
CID 115191556
[1-[(2-methoxy-3,5-dimethylanilino)methyl]cyclopropyl]methanol
CID 115243235
ethane;2-methoxy-1,3,5-trimethylbenzene
CID 142174927
1-N-(2-methoxy-3,5-dimethylphenyl)-4-methylbenzene-1,2-diamine
CID 115124927
N-ethyl-3,5-dimethyl-2-propan-2-yloxyaniline
CID 82267547
5-chloro-N-(chloromethyl)-2-methoxy-3-methylaniline
CID 115262707
N'-(5-chloro-2-methoxy-3-methylphenyl)-2,2-dimethylpropane-1,3-diamine
CID 115199813
N-(5-chloro-2-methoxy-3-methylphenyl)-2-methylbutane-1,4-diamine
CID 115202326

Frequently Asked Questions

What is the IUPAC name of N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline?
The IUPAC name of N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline (CID 115260467) is N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline.
What is the SMILES notation for N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline?
The canonical SMILES for N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline is COc1c(C)cc(C)cc1NCNN.
What is the InChIKey of N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline?
The InChIKey is NMJRUJDGVPPKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-4-8(2)10(14-3)9(5-7)12-6-13-11/h4-5,12-13H,6,11H2,1-3H3.
What are the key properties of N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline?
N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline has a molecular weight of 195.27 g/mol, XLogP of 1.14, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(hydrazinylmethyl)-2-methoxy-3,5-dimethylaniline is sourced from PubChem (CID 115260467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).